2-(5-oxidanylidene-11H-[1]benzoxepino[3,4-d]pyrimidin-7-yl)ethanoic acid

Systemtic Name: 2-(5-oxidanylidene-11H-[1]benzoxepino[3,4-d]pyrimidin-7-yl)ethanoic acid Openeye Name: 2-(5-oxo-11H-[1]benzoxepino[3,4-d]pyrimidin-7-yl)acetic acid CAS Name: 2-(5-oxo-11H-[1]benzoxepino[3,4-d]pyrimidin-7-yl)acetic acid IUPAC Name: 2-(5-oxo-11H-[1]benzoxepino[3,4-d]pyrimidin-7-yl)acetic acid Traditional Name: 2-(5-keto-11H-[1]benzoxepino[3,4-d]pyrimidin-7-yl)acetic acid Formula: C14H10N2O4 MolecularWeight: 270.2402

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(=CC=C2)CC(=O)O)OC(=O)C3=NC=NC=C31

Isomeric SMILES

C1C2=C(C(=CC=C2)CC(=O)O)OC(=O)C3=NC=NC=C31

InChI

InChI=1S/C14H10N2O4/c17-11(18)5-9-3-1-2-8-4-10-6-15-7-16-12(10)14(19)20-13(8)9/h1-3,6-7H,4-5H2,(H,17,18)